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96333-04-9

96333-04-9 structural image
Product Name: 1,2-NAPHTHALENEDIOL, 5,6,7,8-TETRAHYDRO-6-(METHYL-2-PROPYNYLAMINO)-, HYDROBROMIDE
Formula: C14H17NO2
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COMPUTED DESCRIPTORS

Molecular Weight 312.20 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 311.05209 g/mol
Monoisotopic Mass 311.05209 g/mol
Topological Polar Surface Area 43.7 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 309
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes